ethyl 4-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethynyl]benzoate

Systemtic Name: ethyl 4-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethynyl]benzoate Openeye Name: ethyl 4-[2-(3-tert-butyl-4-hydroxy-phenyl)ethynyl]benzoate CAS Name: 4-[2-(3-tert-butyl-4-hydroxyphenyl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-tert-butyl-4-hydroxyphenyl)ethynyl]benzoate Traditional Name: 4-[2-(3-tert-butyl-4-hydroxy-phenyl)ethynyl]benzoic acid ethyl ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC(=C(C=C2)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC(=C(C=C2)O)C(C)(C)C

InChI

InChI=1S/C21H22O3/c1-5-24-20(23)17-11-8-15(9-12-17)6-7-16-10-13-19(22)18(14-16)21(2,3)4/h8-14,22H,5H2,1-4H3